- InChI
- InChI=1S/C16H30O2/c1-14(2)10-7-5-6-8-12-16(17)18-13-9-11-15(3)4/h7,10,14-15H,5-6,8-9,11-13H2,1-4H3/b10-7+
- InChI Key
- OVYHDLFPFWJOMW-JXMROGBWSA-N
- Formula
- C16H30O2
- SMILES
- CC(C)C=CCCCCC(=O)OCCCC(C)C
- Molecular Weight1
- 254.41
- CAS
- 1215128-18-9
- Cp,gas : Ideal gas heat capacity (J/mol×K).
- η : Dynamic viscosity (Pa×s).
- ΔfG° : Standard Gibbs free energy of formation (kJ/mol).
- ΔfH°gas : Enthalpy of formation at standard conditions (kJ/mol).
- ΔfusH° : Enthalpy of fusion at standard conditions (kJ/mol).
- ΔvapH° : Enthalpy of vaporization at standard conditions (kJ/mol).
- log10WS : Log10 of Water solubility in mol/l.
- logPoct/wat : Octanol/Water partition coefficient.
- McVol : McGowan's characteristic volume (ml/mol).
- Pc : Critical Pressure (kPa).
- Inp : Non-polar retention indices.
- Tboil : Normal Boiling Point Temperature (K).
- Tc : Critical Temperature (K).
- Tfus : Normal melting (fusion) point (K).
- Vc : Critical Volume (m3/kmol).
- 1: Molecular weight from the IUPAC atomic weights tables.
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Physical Properties
| Property | Value | Unit | Source |
|---|---|---|---|
| ΔfG° | -74.74 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -511.71 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 33.14 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 59.55 | kJ/mol | Joback Calculated Property |
| log10WS | -4.75 | Crippen Calculated Property | |
| logPoct/wat | 4.738 | Crippen Calculated Property | |
| McVol | 239.440 | ml/mol | McGowan Calculated Property |
| Pc | 1434.80 | kPa | Joback Calculated Property |
| Inp | [1692.20; 1692.20] |
|
|
| Inp | 1692.20 | NIST | |
| Inp | 1692.20 | NIST | |
| Tboil | 645.05 | K | Joback Calculated Property |
| Tc | 822.49 | K | Joback Calculated Property |
| Tfus | 307.16 | K | Joback Calculated Property |
| Vc | 0.923 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [655.91; 752.19] | J/mol×K | [645.05; 822.49] |
|
| Cp,gas | 655.91 | J/mol×K | 645.05 | Joback Calculated Property |
| Cp,gas | 673.97 | J/mol×K | 674.62 | Joback Calculated Property |
| Cp,gas | 691.19 | J/mol×K | 704.20 | Joback Calculated Property |
| Cp,gas | 707.60 | J/mol×K | 733.77 | Joback Calculated Property |
| Cp,gas | 723.22 | J/mol×K | 763.35 | Joback Calculated Property |
| Cp,gas | 738.07 | J/mol×K | 792.92 | Joback Calculated Property |
| Cp,gas | 752.19 | J/mol×K | 822.49 | Joback Calculated Property |
| η | [0.0000905; 0.0041086] | Pa×s | [307.16; 645.05] |
|
| η | 0.0041086 | Pa×s | 307.16 | Joback Calculated Property |
| η | 0.0013293 | Pa×s | 363.48 | Joback Calculated Property |
| η | 0.0005821 | Pa×s | 419.79 | Joback Calculated Property |
| η | 0.0003099 | Pa×s | 476.11 | Joback Calculated Property |
| η | 0.0001885 | Pa×s | 532.42 | Joback Calculated Property |
| η | 0.0001261 | Pa×s | 588.73 | Joback Calculated Property |
| η | 0.0000905 | Pa×s | 645.05 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 4-Methylpentyl 8-methylnon-6-enoate.
Sources
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